SCHEMBL28227136

SCHEMBL28227136

Cc1ccc(N=Cc2ccccc2)c(Cl)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 0.42
ALDH1A1 P00352 9/20 0.42
HPGD P15428 5/20 0.42
RAB9A P51151 3/20 0.42
GAA P10253 9/20 0.42
MAPT P10636 7/20 0.42
SMN1; SMN2 Q16637 4/20 0.42
MEN1 O00255 4/20 0.42
KMT2A Q03164 4/20 0.42
HTT P42858 4/20 0.42
POLB P06746 3/20 0.42
USP2 O75604 2/20 0.42
BLM P54132 1/20 0.42
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA9 Q16790 1/20 0.41
LMNA P02545 5/20 0.39
NPC1 O15118 2/20 0.39
CASP3 P42574 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL30374604 0.82 LMNA (0.49) KDM4EALDH1A1HPGDRAB9AGAA
SCHEMBL11405992 0.82 LMNA (0.49) KDM4EALDH1A1HPGDRAB9AGAA
SCHEMBL11405980 0.82 LMNA (0.49) KDM4EALDH1A1HPGDRAB9AGAA
SCHEMBL12416697 0.82 CA1 (0.43) KDM4EALDH1A1HPGDRAB9AGAA
SCHEMBL11418273 0.82 CA1 (0.43) KDM4EALDH1A1HPGDRAB9AGAA
SCHEMBL11407087 0.79 ALDH1A1 (0.55) KDM4EALDH1A1HPGDRAB9AGAA
SCHEMBL11577321 0.78 ALDH1A1 (0.50) KDM4EALDH1A1HPGDRAB9AGAA
SCHEMBL11404429 0.78 RAB9A (0.58) KDM4EALDH1A1HPGDRAB9AGAA
SCHEMBL11586265 0.78 CA12 (0.40) KDM4EALDH1A1HPGDRAB9AMAPT
SCHEMBL3727585 0.77 MAPT (0.50) KDM4EALDH1A1HPGDRAB9AMAPT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108276294-A A kind of preparation method of fluorine-containing benzidine 上海康鹏科技有限公司 2018-07-13 CN disclosed